ethyl 4-(5-{[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}furan-2-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(5-{[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}furan-2-yl)benzoate
ethyl 4-(5-{[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}furan-2-yl)benzoate
Compound characteristics
| Compound ID: | 4285-2724 |
| Compound Name: | ethyl 4-(5-{[5-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}furan-2-yl)benzoate |
| Molecular Weight: | 420.42 |
| Molecular Formula: | C23 H20 N2 O6 |
| Smiles: | CCOC(c1ccc(cc1)c1ccc(/C=C2/C(C)=C(C#N)C(N(CCO)C2=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0092 |
| logD: | 3.0092 |
| logSw: | -2.8581 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.411 |
| InChI Key: | XYOKQYMGHYWQRJ-UHFFFAOYSA-N |